2-[[2-(1,3-benzoxazol-2-ylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]methylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[2-(1,3-benzoxazol-2-ylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[[2-(1,3-benzoxazol-2-ylamino)-4-oxo-1H-pyrimidin-6-yl]methylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(1,3-benzoxazol-2-ylamino)-4-oxo-1H-pyrimidin-6-yl]methylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[[2-(1,3-benzoxazol-2-ylamino)-4-oxo-1H-pyrimidin-6-yl]methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(1,3-benzoxazol-2-ylamino)-4-keto-1H-pyrimidin-6-yl]methylthio]-6-methyl-1H-pyrimidin-4-one Formula: C17H14N6O3S MolecularWeight: 382.39646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=CC(=O)N=C(N2)NC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=CC(=O)N=C(N2)NC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C17H14N6O3S/c1-9-6-13(24)22-17(18-9)27-8-10-7-14(25)21-15(19-10)23-16-20-11-4-2-3-5-12(11)26-16/h2-7H,8H2,1H3,(H,18,22,24)(H2,19,20,21,23,25)